SCHEMBL20848796

SCHEMBL20848796

Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2-c2ccc(C#N)cc2-n2c3ccccc3c3cc(-c4ccc(C)cc4)ccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 4/20 0.35
PTGER4 P35408 1/20 0.34
AR P10275 1/20 0.34
RXRA P19793 1/20 0.34
RXRG P48443 1/20 0.34
KIF11 P52732 1/20 0.33
PDK2 Q15119 1/20 0.32
ICMT O60725 2/20 0.31
PTPN5 P54829 2/20 0.31
RORC P51449 2/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20849532 0.96 TACR1 (0.35) TACR1PTGER4ARRXRARXRG
SCHEMBL20848521 0.96 PTGER4 (0.35) TACR1PTGER4ARRXRARXRG
SCHEMBL20849549 0.95 TACR1 (0.33) TACR1PTGER4ARRXRARXRG
SCHEMBL20848875 0.95 TACR1 (0.36) TACR1PTGER4ARRXRARXRG
SCHEMBL20848553 0.94 PTGER4 (0.34) TACR1PTGER4ARRXRARXRG
SCHEMBL20848947 0.94 KIF11 (0.39) TACR1PTGER4RXRARXRGKIF11
SCHEMBL20849572 0.94 RXRA (0.35) TACR1PTGER4RXRARXRGKIF11
SCHEMBL20848526 0.93 RXRA (0.38) TACR1PTGER4RXRARXRGKIF11
SCHEMBL20848552 0.93 PTGER4 (0.33) TACR1PTGER4ARRXRARXRG
SCHEMBL20849588 0.93 AR (0.38) TACR1PTGER4ARRXRARXRG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 TACR1 2846/4885PTGER4 3716/4885AR 3706/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 TACR1 2846/4885PTGER4 3716/4885AR 3706/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.